SCHEMBL9718841

SCHEMBL9718841

c1ccc(Nc2nc3c(Nc4ccccc4)cccc3s2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.60
RAB9A P51151 11/20 0.60
SMN1; SMN2 Q16637 10/20 0.60
MEN1 O00255 10/20 0.60
KMT2A Q03164 10/20 0.60
MAPT P10636 8/20 0.60
CASP3 P42574 1/20 0.60
SENP8 Q96LD8 1/20 0.60
SENP7 Q9BQF6 1/20 0.60
SENP6 Q9GZR1 1/20 0.60
ALDH1A1 P00352 6/20 0.51
GAA P10253 5/20 0.51
HPGD P15428 4/20 0.51
LMNA P02545 4/20 0.51
KDM4E B2RXH2 3/20 0.51
PRNP P04156 1/20 0.51
MAPK1 P28482 1/20 0.48
ADORA3 P0DMS8 2/20 0.47
ADORA2A P29274 2/20 0.47
NFKB1 P19838 4/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4915377 0.83 MAPT (0.59) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4916241 0.83 DYRK1A (0.56) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4915371 0.82 MAPT (0.58) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4908696 0.82 NPC1 (0.52) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4921098 0.82 PKM (0.60) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4908655 0.80 GAA (0.50) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4919280 0.80 MAPT (0.48) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4919944 0.79 NPC1 (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4915044 0.79 SMN1; SMN2 (0.55) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4913870 0.79 TRPV1 (0.47) NPC1RAB9ASMN1; SMN2MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5151472-A Dissolving polyetherimides in a solvent, adding a dianhydride and a diamine, reacting to form a polyamic acid and cyclizing to form a polyimide GENERAL DYNAMICS CORPORATION, CONVAIR DIVISION (US) 1992-09-29 US disclosed